Vitas-M small molecule compound

2-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-5,6,10,11-tetrahydro-9H-[1,4]dioxepino[2,3-g]pyrrolo[2,1-a]isoquinoline

Catalog ID
STK575620
SMILES C1COc2c(OC1)cc1c(c2)c2cc(cn2CC1)C12CC3CC(C2)CC(C1)C3

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C25H29NO2 MW 375.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29NO2/c1-4-27-23-9-19-2-3-26-15-20(10-22(26)21(19)11-24(23)28-5-1)25-12-16-6-17(13-25)8-18(7-16)14-25/h9-11,15-18H,1-8,12-14H2
InChIKey
QGPNCLPMRQVUIT-UHFFFAOYSA-N
Synonyms
898913-11-6
2((3r5r7r)adamantan1yl)691011tetrahydro5H(14)dioxepino(23g)pyrrolo(21a)isoquinoline
2(tricyclo(3311~37~)dec1yl)561011tetrahydro9H(14)dioxepino(23g)pyrrolo(21a)isoquinoline
898913116
C1COC2=C(C=C3C(=C2)CCN4C3=CC(=C4)C56CC7CC(C5)CC(C7)C6)OC1
InChI=1SC25H29NO2c14272391923261520(1022(26)21(19)1124(23)2851)251216617(1325)818(716)1425h9111518H181214H2
MFCD07639209
ZINC000005425955
ZINC05425955
ZINC5425955

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Available files

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